Gaillardin
[CAS# 14682-46-3]

Identification

• Name: Gaillardin
• Synonyms: [(3As,5As,6S,8R,8Ar,9Ar)-8-Hydroxy-5,8-Dimethyl-1-Methylene-2-Oxo-5A,6,7,8A,9,9A-Hexahydro-3Ah-Azuleno[6,5-B]Furan-6-Yl] Acetate; Acetic Acid [(3As,5As,6S,8R,8Ar,9Ar)-8-Hydroxy-5,8-Dimethyl-1-Methylene-2-Oxo-5A,6,7,8A,9,9A-Hexahydro-3Ah-Azuleno[6,5-B]Furan-6-Yl] Ester; Acetic Acid [(3As,5As,6S,8R,8Ar,9Ar)-8-Hydroxy-2-Keto-5,8-Dimethyl-1-Methylene-5A,6,7,8A,9,9A-Hexahydro-3Ah-Azuleno[5,6-D]Furan-6-Yl] Ester
• Molecular Formula: C₁₇H₂₂O₅
• Molecular Weight: 306.36
• CAS Registry Number: 14682-46-3
• SMILES: [C@H]23[C@@H](C(=C[C@H]1[C@@H](C(C(=O)O1)=C)C2)C)[C@@H](OC(=O)C)C[C@]3(O)C
• InChI: 1S/C17H22O5/c1-8-5-13-11(9(2)16(19)22-13)6-12-15(8)14(21-10(3)18)7-17(12,4)20/h5,11-15,20H,2,6-7H2,1,3-4H3/t11-,12-,13+,14+,15-,17-/m1/s1
• InChIKey: UTPGJEROJZHISI-DFGCRIRUSA-N

Properties

• Density: 1.236g/cm³ (Cal.)
• Boiling point: 463.072°C at 760 mmHg (Cal.)
• Flash point: 167.108°C (Cal.)